benzo[e][1]benzothiol-2-ylmethyl(triphenyl)phosphanium chloride

Systemtic Name: benzo[e][1]benzothiol-2-ylmethyl(triphenyl)phosphanium chloride Openeye Name: benzo[e]benzothiophen-2-ylmethyl(triphenyl)phosphonium chloride CAS Name: 2-benzo[e][1]benzothiolylmethyl(triphenyl)phosphonium chloride IUPAC Name: benzo[e][1]benzothiol-2-ylmethyl(triphenyl)phosphanium chloride Traditional Name: benzo[e]benzothiophen-2-ylmethyl(triphenyl)phosphonium chloride Formula: C31H24ClPS MolecularWeight: 495.014021

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC3=C(S2)C=CC4=CC=CC=C43)(C5=CC=CC=C5)C6=CC=CC=C6.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC3=C(S2)C=CC4=CC=CC=C43)(C5=CC=CC=C5)C6=CC=CC=C6.[Cl-]

InChI

InChI=1S/C31H24PS.ClH/c1-4-13-25(14-5-1)32(26-15-6-2-7-16-26,27-17-8-3-9-18-27)23-28-22-30-29-19-11-10-12-24(29)20-21-31(30)33-28;/h1-22H,23H2;1H/q+1;/p-1